Book Description
Computeraided process engineering (CAPE) plays a key design and operations role in the process industries, from the molecular scale through managing complex manufacturing sites. The research interests cover a wide range of interdisciplinary problems related to the current needs of society and industry. ESCAPE 23 brings together researchers and practitioners of computeraided process engineering interested in modeling, simulation and optimization, synthesis and design, automation and control, and education. The proceedings present and evaluate emerging as well as established research methods and concepts, as well as industrial case studies.
 Contributions from the international community using computerbased methods in process engineering
 Reviews the latest developments in process systems engineering
Emphasis on industrial and societal challenges
Table of Contents
 Cover image
 Title page
 Table of Contents
 Copyright
 Preface
 International Program Committee
 National Organising Committee

Biomaterial Processing
 Biomass pyrolysis kinetics through thermogravimetric analysis
 Alternatives for the Production of Biodiesel by Supercritical Technologies: A Comparative Study
 Simulation and optimization of a biojet fuel production process
 Conceptual design of hydrogen production process from bioethanol reforming
 A combination of experiments and molecular dynamics simulation for the investigation of the ionexchange adsorption of biological macromolecules
 Integrated optimization of black tea cream effect using statistical analysis
 Modelling, design and operation of a pretreatment reactor for lignocellulosic biomass

Regulatory Control for the Operation of a Simultaneous Saccharification and CoFermentation Reactor for Bioethanol Production.
 1 Introduction
 2 Systematic Methodology for Regulatory Control of Simultaneous Saccharification and CoFermentation reactor for Biothanol Production
 3 The Process of Simultaneous Saccharification and Fermentation
 4 Process Behaviors and Operational Problems
 5 Control System
 6 Performance of the Control System
 7 Conclusion
 References
 Chemometrics for analytical data mining in separation process design for recovery of artemisinin from Artemisia annua
 Production of Methanol and Dimethyl ether from biomass derived syngas – a comparison of the different synthesis pathways by means of flowsheet simulation
 Prediction of biopharmaceutical facility fit issues using decision tree analysis
 Sugar hydrogenation–combined heat and mass transfer
 Multiperiod Synthesis of a Biorefinery’s Supply Networks
 Modeling Integrated Biorefinery Supply Chains
 Kinetics of the Enzymatic Cellulose Hydrolysis by the Endoglucanase from the Extremophile S. solfataricus
 A systematic methodology for optimal product design in an integrated biorefinery
 Effective Optimization Model for Biomass Drying
 Modelbased runtorun optimization under uncertainty of biodiesel production
 Predictive Control Strategy for Temperature Control for Milk Pasteurization Process
 A model based approach to an adaptive design space in chromatography
 Metabolic pathways analysis in PHAs production by Pseudomonas with 13Clabeling experiments
 Implementation aspects of modeling equilibrium reactions and thermodynamic data in a flowsheet simulator

Biomedical Engineering
 Identification of complex models of type 2 diabetes from IVGTT data by modelbased design of experiments
 An Integrated Computational Model of Powder Release, Dispersion, Breakage, and Deposition in a Dry Powder Inhaler
 Scaling the Endocrine System from Rats to Humans
 Design of vascular tree for organ bioprinting
 Mixed integer optimisation of antibody purification processes
 Novel twosteps optimal control of batch polymerization reactors and application to PMMA production for the fabrication of artificial bone tissue
 Using an Iterative Dynamic Programming Algorithm to Solve an Immunotherapy Model
 Structure Based Design of NonPeptide Mimetics
 Genomescale metabolic network reconstruction and in silico analysis of Methanococcus maripaludis S2

Energy Systems
 TechnoEconomic Analysis of a Natural Gas Combined Cycle Power Plant with CO2 Capture
 A Superstructure Based Mixedinteger Programming Approach to the Optimal Design of a Pipelines Network for CO2 Transport
 Evaluation of chemical looping systems as carbon capture option to be applied to gasification processes
 Building modeling: on selection of the model complexity for predictive control
 Dual control within MPC framework
 Optimization of an Ethanol Dehydration Process Using Differential Evolution Algorithm
 Reactive distillation for production of nbutyl acrylate from biobased raw materials
 LargeScale Validation of a Numerical Model of Accidental Releases from Buried CO2 Pipelines
 Operation of energy efficient divided wall column

Using External Recycle for Design of Reactive Distillation Columns
 1 Introduction
 2 Principle of the RDCTBER
 3 Synthesis and Design of the RDCTBER
 4 Example I: Separation of a Hypothetical Exothermic Reaction
 5 Example II: Separation of a Hypothetical Endothermic Reaction
 6 Example III: Separation of the Lactic Acid Esterification with Methanol
 7 Discussion
 8 Conclusions
 References
 A Three Dimensional Dynamic CFD Simulation for the Direct DME Production in a Fixed Bed Reactor
 Inertial Particle Behaviour in Turbulent Fluid Flow
 ResourceTask Network Based Approach for Industrial Demand Side Management of Steel Production
 Computeraided Modeling and Optimization of Thermal Efficiency for Multifuel Boiler
 A Parallel Method with Hybrid Algorithms for Mixed Integer Nonlinear Programming
 Reactive Scheduling of micro Combined Heat and Power Systems via Multiparametric Programming
 Modelling and identification of the dominant phenomena in hydrogen fuelcells by the application of DRT Analysis
 Molecular Design of Working Fluid Mixtures for Organic Rankine Cycles
 A Novel Hybrid Direct Search Method for Constrained NonSmooth BlackBox Problems
 Limestone dissolution study for Wet Flue Gas Desulfurization under turbulent regimes above critical suspension speed
 Intensifying heat transfer for retrofitting heat exchanger networks with topology modifications
 A Conceptual Design Algorithm for SingleFeed Hybrid Reactive Distillation Column involving azeotropic systems
 Online modeling of NOx formation in a coal boiler
 Supervisory Control for Real Time Reactive Power Flow Optimization in Islanded Microgrids
 On the synthesis of multicomponent distillation configurations with nonsharp splits
 Multiobjective optimization of SNG production through hydrothermal gasification from microalgae
 Modelbased Assessment of the Role of Natural Gasbased MicroCHP in Residential Energy Supply Systems
 Energy Integration in the cement industry
 Estimation of enhanced heat transfer area targets in process industries
 Capital Cost Assessment for Total Site Power Cogeneration
 Process engineering method for systematically comparing CO2 capture options
 Optimal synthesis and design of extractive distillation systems for bioethanol separation: from simple to complex columns
 Modeling and Simulation for AbsorptionDesorption Cyclic Process on a ThreeStage Metal Hydride Hydrogen Compressor
 Convex Relaxations of Multivariate Composite Functions
 Optimization of binary geothermal power systems
 Profit optimization for biogas upgrading PSA process based on controlling steptime
 Continuoustime Batch Scheduling Approach for Optimizing Electricity Consumption Cost
 CPU Heat Sink Cooled by Nanofluids and Water: Experimental and Numerical Study
 GWh Level Renewable Energy Storage and Supply using Liquid CO2
 Simulation, Analysis, and Assessment of CO2 Enhanced Biomass Gasification
 Forecasting CO2 emissions due to gasifier degradation by timeseries analysis
 Heat Exchanger Network Design and Economic Analysis for Coalfired Power Plant retrofitted with CO2 Capture
 Overall Optimization of a Comprehensive Utility System
 Constraint handling in stochastic optimization algorithms for natural gas liquefaction processes
 Dynamic modelling and control of a pilot plant for postcombustion CO2 capture
 Enhanced configurations for polyesters synthesis by reactive distillation
 Multiobjective, multiperiod optimization of district energy systems: Networks design

Management & Economics
 A Metaheuristic Optimization Algorithm for Binary Quadratic Problems
 Risk management in the design and planning of closedloop supply chains
 Integrated scheduling and control of a polymerization reactor with online closedloop implementation
 Reformulation strategies for eigenvalue optimization using Sylvester’s criterion and Cholesky decomposition
 Design of Biofuel Supply Chains under Uncertainty with Multiobjective Stochastic Programming Models and Decomposition Algorithm
 Intelligent Alarm System applied to Continuous Pharmaceutical Manufacturing
 A multiproduct batch plant design model incorporating production planning and scheduling decisions under a multiperiod scenario
 Supporting the transfer of products between different equipment through latent variable model inversion
 Tactical Planning with ShelfLife Constraints in the FMCG Industry
 OFIS – Ontological Framework for Industrial Symbiosis
 Refinement strategies for piecewise linear functions utilized by reformulationbased techniques for global optimization
 comparison of two convex underestimation methods for quadratic functions
 A new methodology to identify supply chains sustainability bottlenecks
 Simplified model for integrated Supply Chains Planning
 Hybrid time representation for the scheduling of energy supply and demand in smart grids
 Supply Chain Management – Optimal Planning for Sustainable Products’ Portfolio
 Evaluating the Effectiveness of Anticipatory Alarms for Proactive Process Monitoring
 MediumTerm Production Scheduling of a LargeScale Steelmaking Continuous Casting Process under Demand Uncertainty
 Design of Supply Chains under the Risk of Facility Disruptions
 A Multiproduct Feedstock Optimization Model for Polymer Production
 A comprehensive CP approach for the scheduling of resourceconstrained multiproduct multistage batch plants
 A Mixed Integer Linear Program decomposition solution to the scheduling activities in a realworld pipeline used to transport heavy oil derivatives.
 Framework to to Generate Engineering Standard for Plant Maintenance
 Overview for Management of Change based on Business Process Model of Plant Lifecycle
 Development of a Sustainable Copper Scrap Management Model
 Forecasting research trends using population dynamics model with Burgers’ type interaction
 Reliability of operating window identified from process data
 An improved MILP model for scheduling crude oil unloading, storage and processing
 Mathematical Knowledge Management for Enterprise Decision Making
 A spatiallyexplicit approach to the design of ethanol supply chains considering multiple technologies and carbon trading effects
 An Efficient MILP Approach for the ShortTerm Planning of Refined Products Blending and Distribution Operations
 A Novel Graphical Method for Controllability Analysis of Chemical Process Designs
 Design of a Generic and Flexible Data Structure for Efficient Formulation of Large Scale Network Problems
 Testing and analyzing different training methods for industrial operators: an experimental approach
 Design and Optimization of Biofuel Supply Chain Network in UK
 A methodology to forecast the price of electric energy
 Improving Lead Time of Sterile Drug Product Manufacturing Using Monte Carlo Simulation
 Multistage stochastic optimization of the design and planning of a ClosedLoop Supply Chain
 Business Model of Continuous Improvement in Pharmaceutical Production Processes

Sustainability of Products and Processes
 Leak Identification in a Water Distribution Network using Sparse Flow Measurements
 Multiobjective optimisation of the operation of a water distribution network
 A methodology for simultaneous product and process design in the customer products industry: The case study of the laundry business
 Dynamic optimization of semibatch emulsion copolymerization reactor for styrene/butyl acrylate in the presence of a chain transfer agent

Ecodesign and Life Cycle Assessment of a chemical process: the case study of HDA
 1 Introduction
 2 Modelling the HDA process and its associated utility production system (UPS)
 3 Multiobjective optimization of the HDA process – Fuel oil turbine
 4 Pareto front interpretation and use of MDCM tools
 5 Life Cycle Assessment (LCA) of the TF2 solution
 6 Coupling HDA process with a natural gas turbine as UPS and discussion
 7 Conclusions
 References
 Life Cycle Energy, Environmental and Economic Comparative Analysis of CdTe Thinfilm Photovoltaics Domestic and Overseas Manufacturing Scenarios
 Optimization of Batch and Semibatch Reactors
 Decision tool for the selection among different reverse osmosis membranes for hydrogen peroxide ultrapurification
 Process Fault Diagnosis Based on Bayesian Inference
 Hybrid advanced control of flexible multipurpose continuous tablet manufacturing process via direct compaction
 A hybrid GASQP multiobjective optimization methodology for carbon monoxide pollution minimization in Fluid Catalytic Cracking Process
 Control of a Biological Nitrogen Removal Process in an Intensified Single Reactor Configuration
 Computeraided modeling framework – a generic modeling template for catalytic membrane fixed bed reactors
 Model based optimal experimental design  a semidefinite programming approach applied to a solvent design problem
 Control of the particle size distribution in emulsion polymerization by midcourse correction using a hybrid model
 Optimization of biohydrogen production and CN removal in combined anaerobicaerobic systems
 Optimal Design of SWRO Desalination Processes with Boron Level Considerations
 Selecting the best control methodology to improve the efficiency of discontinuous reactors
 Total plant integrated optimization of sulfur recovery and steam generation for Claus processes using detailed kinetic schemes
 Design of an Emulsionbased Personal Detergent through a Modelbased Chemical Product Design Methodology
 Industrial Application of Sustainable Retrofit Design
 Geometry optimization of photochemical reactors for advanced oxidation processes
 Design of Sustainable Blended Products using an Integrated Methodology
 A Modeling Approach for Dispersive Mixing of Oil in Water Emulsions
 ParticleInteraction Effects in Turbulent Channel Flow
 Sensitivitybased Mnemonic Enhancement Optimization (SMEO) for Realtime Optimization of Chemical Process
 Prediction of the Full Molecular Weight Distribution in RAFT Polymerization using Probability Generating Functions
 INOSIM Bio  new approaches for bioprocess simulation and optimization
 APROSNIMBUS: Dynamic Process Simulator and Interactive Multiobjective Optimization in Plant Automation
 Spatially Distributed Fines Removal in a Continuous Plug Flow Crystallizer by Optimal Temperature Profile with Controlled Dissolution
 Cellular automata modeling of dissolution of soliddosage forms
 A framework for sustainability of coal based energy and chemical processes
 Towards supply chain sustainability: balancing costs with environmental and social impacts
 FaultTolerant SelfReconfigurable Control System
 Optimal design of a solidliquid separation system
 Global sensitivity analysis of a mineral processing flowsheet
 An Integrated Platform for Optimization of Heat and Water Use in Multipurpose Batch Plants
 Control System Development for Integrated Biological Waste Water Treatment Process of a Paper Production Plant
 Applicability of Sustainability Indicators to Wastewater Treatment Processes
 An Uncertainty Assessment Framework for LCAbased Environmental Process Design
 Optimal recipe design for Paracetamol degradation by advanced oxidation processes (AOPs) in a pilot plant
 Efficient Waste Management based on Scheduling Optimization of Waste Treatment Plants
 Design of Ionic Liquids Using Property Clustering and Decomposition Techniques
 A novel approach to hybrid evolutionarydeterministic optimization in process design
 Control of a batch reactor using constrained direct inverse
 Taylor Models in Deterministic Global Optimization for LargeScale Systems with Few Degrees of Freedom
 Enclosing the Reachable Set of Parametric ODEs using Taylor Models and Ellipsoidal Calculus
 Synthesis and design of optimal biorefinery using an expanded network with thermochemical and biochemical biomass conversion platforms
 Automated HAZOP using hybrid discrete/continuous process models
 Advanced control strategy for NOx reduction in forced unsteadystate reactors
 Advanced Control Used for Counteracting Accidental Pollutant Propagation in Rivers
 Nonlinear process monitoring by integrating manifold learning with Gaussian process
 Dynamic effects of diabatization in distillation columns
 On the integration of model identification and process optimization
 Introduction of social criteria for the optimal location of Construction and Demolition Waste management facilities in Cantabria (Spain)
 Optimization under Uncertainty of Pollutant Discharges Reduction Strategies on Drainage Systems
 Shortcut method for the design of extraction columns for multicomponent mixture separations
 Modeling of Gold Leaching with Thiosulphate Solutions in Different Types of Reactor
 An agent based model for the exploration and assessment of sulfur technology for upstream stranded gas fields
 Author Index
Product Information
 Title: 23rd European Symposium on Computer Aided Process Engineering
 Author(s):
 Release date: June 2013
 Publisher(s): Elsevier
 ISBN: 9780444632340